1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea

Systemtic Name: 1-[(6-methoxy-2-oxidanylidene-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea Openeye Name: 1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea CAS Name: 1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-[2-(1-pyrrolidin-1-iumyl)ethyl]urea IUPAC Name: 1-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea Traditional Name: 1-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]-3-(4-methoxyphenyl)-1-(2-pyrrolidin-1-ium-1-ylethyl)urea Formula: C25H31N4O4+ MolecularWeight: 451.53804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)N(CC[NH+]2CCCC2)CC3=CC4=C(C=CC(=C4)OC)NC3=O

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)N(CC[NH+]2CCCC2)CC3=CC4=C(C=CC(=C4)OC)NC3=O

InChI

InChI=1S/C25H30N4O4/c1-32-21-7-5-20(6-8-21)26-25(31)29(14-13-28-11-3-4-12-28)17-19-15-18-16-22(33-2)9-10-23(18)27-24(19)30/h5-10,15-16H,3-4,11-14,17H2,1-2H3,(H,26,31)(H,27,30)/p+1